SCHEMBL3169236

SCHEMBL3169236

CCOc1ccccc1CNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN3A Q9NY46 4/20 0.68
ALDH1A1 P00352 3/20 0.57
PKM P14618 2/20 0.57
RXFP1 Q9HBX9 2/20 0.54
MAPK1 P28482 2/20 0.54
LMNA P02545 1/20 0.54
GAA P10253 1/20 0.54
ALOX12 P18054 1/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
ALOX15 P16050 1/20 0.50
HPGD P15428 1/20 0.50
CA1 P00915 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3158971 0.91 SCN3A (0.70) SCN3AALDH1A1PKMMAPK1LMNA
SCHEMBL3158516 0.87 SCN3A (0.71) SCN3AALDH1A1PKMRXFP1MAPK1
SCHEMBL3154221 0.87 SCN3A (0.66) SCN3AALDH1A1PKMRXFP1MAPK1
SCHEMBL3169000 0.86 SCN3A (0.74) SCN3AALDH1A1PKMRXFP1LMNA
SCHEMBL3154212 0.84 SCN3A (0.74) SCN3AALDH1A1RXFP1LMNAALOX12
SCHEMBL3173874 0.82 SCN3A (0.74) SCN3AALDH1A1PKMRXFP1LMNA
SCHEMBL3160517 0.82 SCN3A (0.68) SCN3AALDH1A1PKMRXFP1MAPK1
SCHEMBL3169833 0.82 SCN3A (0.62) SCN3AALDH1A1PKMRXFP1MAPK1
SCHEMBL3167991 0.82 SCN3A (0.71) SCN3AALDH1A1RXFP1LMNAALOX12
SCHEMBL3161304 0.81 SCN3A (1.00) SCN3AALDH1A1PKMRXFP1MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8741934-B2 Inhibitors of ion channels PFIZER LIMITED (GB) 2014-06-03 US disclosed
US-20130072471-A1 Inhibitors of Ion Channels MARRON BRIAN EDWARD (US) 2013-03-21 US disclosed
US-8357711-B2 Heterocyclic sulfonamides as inhibitors of ion channels PFIZER LIMITED (GB) 2013-01-22 US disclosed
EP-1995241-B1 Inhibitors of ion channels ICAGEN INC (US) 2010-03-17 EP disclosed
US-20090143358-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (US) 2009-06-04 US disclosed
EP-1995241-A1 Inhibitors of ion channels ICAgen, Incorporated (US) 2008-11-26 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130072471-A1 Inhibitors of Ion Channels TRPV1, TRPV5, TRPA1 SCN3A 13/4885ALDH1A1 3113/4885PKM 2728/4885
US-20090143358-A1 INHIBITORS OF ION CHANNELS TRPV1, TRPV5, TRPA1 SCN3A 13/4885ALDH1A1 3113/4885PKM 2728/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.